Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SDCBP | O00560 | 1/20 | 0.36 |
| ▸ | SDC2 | P34741 | 1/20 | 0.36 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.34 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.34 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL23309876 | 1.00 | MEN1 (0.36) | MEN1KMT2ASDCBPSDC2CUL4A | |
| SCHEMBL18793920 | 0.82 | MEN1 (0.41) | MEN1KMT2ACUL4AGABRA1GABRG2 | |
| SCHEMBL19475669 | 0.82 | HSD17B3 (0.39) | MEN1KMT2ASDCBPSDC2GABRA1 | |
| SCHEMBL2178347 | 0.80 | GABRA1 (0.36) | MEN1KMT2ASDCBPSDC2CUL4A | |
| SCHEMBL18765683 | 0.78 | GABRA1 (0.43) | MEN1KMT2ACUL4AGABRA1GABRG2 | |
| SCHEMBL16099526 | 0.77 | SDCBP (0.47) | MEN1KMT2ASDCBPSDC2HSD17B3 | |
| SCHEMBL23309869 | 0.75 | ROCK1 (0.39) | — | |
| SCHEMBL17141692 | 0.71 | PIK3CA (0.46) | MEN1KMT2AGABRA1GABRG2GABRB3 | |
| SCHEMBL29507022 | 0.71 | MEN1 (0.59) | MEN1KMT2ACUL4AGABRA1GABRG2 | |
| SCHEMBL290015 | 0.71 | MEN1 (0.59) | MEN1KMT2ACUL4AGABRA1GABRG2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110831939-A | 6-pyrimidine-isoindole derivatives as ERK1/2 inhibitors | 大冢制药株式会社 | 2020-02-21 | — | — | CN | disclosed |